Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "354f805a60b8aab9d76e74de82467799",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 66.666,
"b": 37.159,
"c": 61.859,
"alpha": 90.00,
"beta": 110.04,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.630,1.200],
"number_observations": 246169,
"number_observations_unique": 42941,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 16.300
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.220,1.200],
"number_observations": 7177,
"number_observations_unique": 2016,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.787
},
{
"type": "R(pim)",
"value": 0.476
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 93.700
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.688
}
]
},
{
"resolution_limits": [32.630,6.570],
"number_observations": 1857,
"number_observations_unique": 297,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 48.800
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}